A0A077ZLZ9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLZ9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 121 aa.

						>A0A077ZLZ9_TRITR|A0A077ZLZ9
MRERDPYKFNQTKKSSRKKAKRNFSYLSPTIQSADMRNPAIFVTMATILLTIFNDFSIDALPDKDKSLPTNNEQGAEKMLSLQTSKQAAENSKAKRSLFMTVFDDLRLVEELKKLKTTPSP
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.8	Very low	54	Low	244 Å²	244	188.2 Å²	188.2	100%	1.202	85%	0.854	S	S	*	*				0	120.5	0	-75.2	165.2	147.8	0	0	107.3	E3	M1-E3 PolarHBondContact O-N 3.35Å
2	R	54.9	Low	53.2	Low	251 Å²	251	182.7 Å²	182.7	95%	0.947	85%	0.845	S	S	*	*			trans	-79.7	109.9	-179.2	-80.4	-176.3	-171.5	167.4	3.8	109.2	R4	R2-R4 PolarHBondContact O-N 3.19Å
3	E	56.8	Low	52.9	Low	192 Å²	192	185 Å²	185	90%	0.897	85%	0.851	S	S	*	*			trans	-56.9	119.9	170.9	-72.4	176	154.3	0	0	109.4	M1 D5	M1-E3 PolarHBondContact O-N 3.35Å; E3-D5 PolarHBondContact O-N 3.49Å
4	R	57.4	Low	52.7	Low	238 Å²	238	184.9 Å²	184.9	90%	0.898	85%	0.848	S	S	*	*			trans	-86.6	104	171.5	-72.9	-170.4	-174.2	-166.5	3.1	107.4	R2 P6	R2-R4 PolarHBondContact O-N 3.19Å; R4-P6 WeakPolarHBondContact O-CD 3.35Å
5	D	62.6	Low	52.5	Low	131 Å²	131	179.7 Å²	179.7	70%	0.701	84%	0.841	S	S	*	*			trans	-58.1	115.5	176	-124.4	-29.4	0	0	0	110.7	E3 Y7	E3-D5 PolarHBondContact O-N 3.49Å; D5-Y7 PolarHBondContact O-N 3.3Å
6	P	60.1	Low	52.4	Low	105 Å²	105	175 Å²	175	68%	0.682	83%	0.834	S	S	*	*	G	3₁₀ helix	trans	-74.1	-5.3	-173	28.1	-33.6	0	0	0	113.8	R4 K8	R4-P6 WeakPolarHBondContact O-CD 3.35Å; P6-K8 PolarHBondContact O-N 3.42Å
7	Y	56.9	Low	52.3	Low	200 Å²	200	178.2 Å²	178.2	78%	0.784	84%	0.836	S	S	*	*	G	3₁₀ helix	trans	-86.7	-0	-174.3	-73.6	-80	0	0	0	115.3	D5	D5-Y7 PolarHBondContact O-N 3.3Å
8	K	52.5	Low	52.3	Low	202 Å²	202	178.7 Å²	178.7	88%	0.878	84%	0.835	S	S	*	*	G	3₁₀ helix	trans	-87.2	4.1	-177.3	-108.5	-173.9	-177.6	-178.5	0	116.6	P6	P6-K8 PolarHBondContact O-N 3.42Å
9	F	53.8	Low	52.4	Low	191 Å²	191	179.4 Å²	179.4	84%	0.838	84%	0.835	S	S	*	*	G	3₁₀ helix	trans	-97.4	-0.4	-178.2	-158.4	-104.5	0	0	0	115.6
10	N	47.4	Very low	52.4	Low	134 Å²	134	174.7 Å²	174.7	72%	0.717	83%	0.828	S	S	*	*			trans	-113.7	78.5	-177	-73.2	-32.9	0	0	0	111.3
11	Q	43.9	Very low	52.4	Low	182 Å²	182	174.9 Å²	174.9	85%	0.85	83%	0.825	S	S	*	*			trans	176.5	101.6	155.5	-99.2	164.7	93.3	0	0	107.4
12	T	44.7	Very low	52.6	Low	122 Å²	122	171.4 Å²	171.4	75%	0.748	80%	0.799	S	S	*	*				-164.1	96.1	73.7	36.1	0	0	0	0	110.1	K14	T12-K14 VanDerWaalsContact C-N 3.26Å; T12-K14 PolarHBondContact O-N 2.85Å
13	K	49	Very low	52.2	Low	213 Å²	213	165.9 Å²	165.9	93%	0.926	79%	0.788	S	S	*	*			trans	-67.3	87.7	153.7	-70.6	-179.6	179.9	176.7	0	108
14	K	49.5	Very low	51.7	Low	184 Å²	184	161 Å²	161	80%	0.8	76%	0.764	S	S	*	*			trans	-128.2	81	159.8	-73.5	-169.7	-179.5	178.8	0	108.4	T12 S16	T12-K14 VanDerWaalsContact C-N 3.26Å; T12-K14 PolarHBondContact O-N 2.85Å; K14-S16 PolarHBondContact O-N 3Å
15	S	50.1	Low	51.3	Low	107 Å²	107	154.6 Å²	154.6	75%	0.748	76%	0.756	S	S	*	*			trans	-61.4	87.4	163.4	63.9	0	0	0	0	108.6	R17	S15-R17 PolarHBondContact O-N 2.84Å
16	S	51.5	Low	50.9	Low	104 Å²	104	156.1 Å²	156.1	73%	0.727	75%	0.753	S	S	*	*			trans	-70.3	74.7	157.7	-84	0	0	0	0	107.4	K14 K18	K14-S16 PolarHBondContact O-N 3Å; S16-K18 PolarHBondContact O-N 3.15Å
17	R	50.6	Low	50.2	Low	229 Å²	229	155.1 Å²	155.1	86%	0.864	74%	0.741	S	S	*	*			trans	-66.2	75.3	154.8	-84.2	-176.4	-179.1	165	0.4	105.8	S15 K19	S15-R17 PolarHBondContact O-N 2.84Å; R17-K19 PolarHBondContact O-N 2.77Å
18	K	52	Low	49.5	Very low	188 Å²	188	148.2 Å²	148.2	82%	0.817	72%	0.723	S	S	*	*			trans	-57.5	100.3	155.6	-79.1	-174.4	177.8	-179.4	0	103.7	S16 A20	S16-K18 PolarHBondContact O-N 3.15Å; K18-A20 PolarHBondContact O-N 2.84Å
19	K	53.4	Low	49.4	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.835	71%	0.711	S	S	*	*			trans	-56.2	97.6	164.2	-75.9	-175.2	177.5	-178	0	104	R17 K21	R17-K19 PolarHBondContact O-N 2.77Å; K19-K21 PolarHBondContact O-N 3.19Å
20	A	53	Low	49	Very low	84 Å²	84	138.8 Å²	138.8	69%	0.694	70%	0.699	S	S	*	*			trans	-59.7	96.7	163.6	0	0	0	0	0	103.7	K18 R22	K18-A20 PolarHBondContact O-N 2.84Å; A20-R22 PolarHBondContact O-N 2.79Å
21	K	53	Low	49	Very low	179 Å²	179	135.3 Å²	135.3	78%	0.778	68%	0.68	S	S	*	*			trans	-58.6	96.1	157.5	-72	-175.9	178.3	-176.4	0	102.5	K19 N23	K19-K21 PolarHBondContact O-N 3.19Å; K21-N23 PolarHBondContact O-N 3.08Å
22	R	51.4	Low	49.1	Very low	171 Å²	171	135.4 Å²	135.4	65%	0.645	68%	0.68	S	S	*	*			trans	-61.9	87.9	168.2	-89.4	176.8	143.1	171	-6.8	104.1	A20 F24	A20-R22 PolarHBondContact O-N 2.79Å; R22-F24 HydrophobicContact CB-CD2 4.03Å; R22-F24 HydrophobicContact CB-CE2 3.73Å; R22-F24 HydrophobicContact CB-CZ 4.05Å; R22-F24 HydrophobicContact CG-CZ 4.39Å; R22-F24 WeakPolarHBondContact O-CD2 3.33Å; R22-F24 PolarHBondContact O-N 3.01Å
23	N	47.6	Very low	49.3	Very low	136 Å²	136	134.6 Å²	134.6	73%	0.727	68%	0.68	S	S	*	*			trans	-67.6	87.9	165.5	-67	-19.3	0	0	0	103.9	K21 S25	K21-N23 PolarHBondContact O-N 3.08Å; N23-S25 PolarHBondContact O-N 3.06Å
24	F	45.8	Very low	49.5	Very low	90 Å²	90	126.1 Å²	126.1	40%	0.395	65%	0.649	S	S	.	*			trans	-68	73.7	166.2	-67.6	-71.6	0	0	0	106.8	R22 Y26 L27	R22-F24 HydrophobicContact CB-CD2 4.03Å; R22-F24 HydrophobicContact CB-CE2 3.73Å; R22-F24 HydrophobicContact CB-CZ 4.05Å; R22-F24 HydrophobicContact CG-CZ 4.39Å; R22-F24 WeakPolarHBondContact O-CD2 3.33Å; R22-F24 PolarHBondContact O-N 3.01Å; F24-Y26 HydrophobicContact CB-CE1 4.08Å; F24-Y26 AromaticContact CD1-CE1 3.49Å; F24-Y26 HydrophobicContact CD1-CE1 3.49Å; F24-Y26 VanDerWaalsContact CD1-CE1 3.49Å; F24-Y26 AromaticContact CD1-CZ 3.51Å; F24-Y26 WeakPolarHBondContact CD1-OH 3.49Å; F24-Y26 HydrophobicContact CE1-CE1 4.37Å; F24-Y26 WeakPolarHBondContact CE1-OH 3.29Å; F24-Y26 HydrophobicContact CG-CE1 4.26Å; F24-Y26 PolarHBondContact O-N 3.07Å; F24-Y26 VanDerWaalsContact O-N 3.15Å; F24-L27 HydrophobicContact CB-CD1 4.26Å; F24-L27 PolarHBondContact O-N 3.46Å
25	S	48.2	Very low	49.7	Very low	102 Å²	102	121.8 Å²	121.8	71%	0.713	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-69	-9.8	-174.4	83.9	0	0	0	0	112.8	N23 L27 S28	N23-S25 PolarHBondContact O-N 3.06Å; S25-L27 VanDerWaalsContact C-N 3.28Å; S25-S28 PolarHBondContact O-N 3.43Å
26	Y	53.9	Low	49.9	Very low	163 Å²	163	118.7 Å²	118.7	64%	0.639	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-75.8	-16.1	171.7	61.5	-101.5	0	0	0	112.9	F24 S28	F24-Y26 HydrophobicContact CB-CE1 4.08Å; F24-Y26 AromaticContact CD1-CE1 3.49Å; F24-Y26 HydrophobicContact CD1-CE1 3.49Å; F24-Y26 VanDerWaalsContact CD1-CE1 3.49Å; F24-Y26 AromaticContact CD1-CZ 3.51Å; F24-Y26 WeakPolarHBondContact CD1-OH 3.49Å; F24-Y26 HydrophobicContact CE1-CE1 4.37Å; F24-Y26 WeakPolarHBondContact CE1-OH 3.29Å; F24-Y26 HydrophobicContact CG-CE1 4.26Å; F24-Y26 PolarHBondContact O-N 3.07Å; F24-Y26 VanDerWaalsContact O-N 3.15Å; Y26-S28 VanDerWaalsContact C-N 3.26Å
27	L	45.1	Very low	50.2	Low	84 Å²	84	122.2 Å²	122.2	44%	0.44	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-95.1	27.7	171.3	-74.6	161.1	0	0	0	111.7	F24 S25 L98	F24-L27 HydrophobicContact CB-CD1 4.26Å; F24-L27 PolarHBondContact O-N 3.46Å; S25-L27 VanDerWaalsContact C-N 3.28Å; L27-L98 HydrophobicContact CD1-CD1 4.07Å; L27-L98 HydrophobicContact CD2-CD1 3.76Å; L27-L98 HydrophobicContact CG-CD1 4.47Å
28	S	44.2	Very low	51	Low	56 Å²	56	115.1 Å²	115.1	39%	0.392	59%	0.586	S	S	.	*			trans	-45.2	132.5	167.5	174.3	0	0	0	0	109.4	S25 Y26 T30	S25-S28 PolarHBondContact O-N 3.43Å; Y26-S28 VanDerWaalsContact C-N 3.26Å; S28-T30 VanDerWaalsContact CB-OG1 3.27Å; S28-T30 WeakPolarHBondContact CB-OG1 3.19Å; S28-T30 PolarHBondContact O-N 3.43Å; S28-T30 PolarHBondContact OG-OG1 3.16Å
29	P	49	Very low	51.6	Low	97 Å²	97	110.5 Å²	110.5	63%	0.63	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-68.1	24.4	176.9	29.3	-33.3	0	0	0	112.9	I31 Q32	P29-I31 PolarHBondContact O-N 3.07Å; P29-Q32 WeakPolarHBondContact O-CB 3.41Å; P29-Q32 PolarHBondContact O-N 2.81Å
30	T	45.3	Very low	52.4	Low	97 Å²	97	103.9 Å²	103.9	60%	0.595	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-59	-13.2	171.1	-22	0	0	0	0	112.5	S28 Q32	S28-T30 VanDerWaalsContact CB-OG1 3.27Å; S28-T30 WeakPolarHBondContact CB-OG1 3.19Å; S28-T30 PolarHBondContact O-N 3.43Å; S28-T30 PolarHBondContact OG-OG1 3.16Å; T30-Q32 PolarHBondContact O-N 3.33Å
31	I	48.1	Very low	53.2	Low	61 Å²	61	101.6 Å²	101.6	31%	0.313	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-72	-18.2	173.2	-52.7	175.4	0	0	0	111.5	P29 S33 A34 M36 M45	P29-I31 PolarHBondContact O-N 3.07Å; I31-S33 PolarHBondContact O-N 3.46Å; I31-A34 PolarHBondContact O-N 3.22Å; I31-M36 HydrophobicContact CG2-CE 4.47Å; I31-M36 HydrophobicContact CG2-SD 4.12Å; I31-M45 HydrophobicContact CD1-CE 3.83Å
32	Q	46.6	Very low	53.9	Low	184 Å²	184	96.6 Å²	96.6	86%	0.86	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-56.7	-18.8	176.5	-88.8	-172.1	-8.9	0	0	114	P29 T30	P29-Q32 WeakPolarHBondContact O-CB 3.41Å; P29-Q32 PolarHBondContact O-N 2.81Å; T30-Q32 PolarHBondContact O-N 3.33Å
33	S	48.5	Very low	54.8	Low	105 Å²	105	92.5 Å²	92.5	73%	0.734	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-134	7	178.5	63.5	0	0	0	0	114.2	I31 D35	I31-S33 PolarHBondContact O-N 3.46Å; S33-D35 PolarHBondContact O-N 3.02Å; S33-D35 VanDerWaalsContact O-N 3.14Å
34	A	51.8	Low	56.1	Low	35 Å²	35	89.7 Å²	89.7	29%	0.289	49%	0.492	S	S	.	.	S	Bend	trans	-64.4	120.7	170.2	0	0	0	0	0	106.3	I31 M36 I41	I31-A34 PolarHBondContact O-N 3.22Å; A34-M36 VanDerWaalsContact C-N 3.28Å; A34-M36 WeakPolarHBondContact O-CG 3.37Å; A34-M36 PolarHBondContact O-N 2.78Å; A34-I41 HydrophobicContact CB-CD1 3.94Å
35	D	55.3	Low	57.3	Low	93 Å²	93	86.5 Å²	86.5	50%	0.497	48%	0.478	S	S	.	.			trans	-62.3	94.2	-176.9	-171.1	8.4	0	0	0	108.7	S33 R37 N38 I41	S33-D35 PolarHBondContact O-N 3.02Å; S33-D35 VanDerWaalsContact O-N 3.14Å; D35-R37 PolarHBondContact O-N 2.8Å; D35-R37 WeakPolarHBondContact OD1-CB 3.32Å; D35-R37 WeakPolarHBondContact OD1-CD 3.44Å; D35-R37 WeakPolarHBondContact OD1-CG 3.49Å; D35-R37 PolarHBondContact OD1-N 3.31Å; D35-R37 IonicContact OD1-NE 3.99Å; D35-N38 WeakPolarHBondContact O-CB 3.36Å; D35-N38 PolarHBondContact O-N 2.98Å; D35-I41 WeakPolarHBondContact O-CD1 3.42Å
36	M	54.6	Low	58.3	Low	42 Å²	42	83.5 Å²	83.5	21%	0.207	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-2.5	-178.5	-59.5	-60.9	-89.6	0	0	112	I31 A34 I41 V109	I31-M36 HydrophobicContact CG2-CE 4.47Å; I31-M36 HydrophobicContact CG2-SD 4.12Å; A34-M36 VanDerWaalsContact C-N 3.28Å; A34-M36 WeakPolarHBondContact O-CG 3.37Å; A34-M36 PolarHBondContact O-N 2.78Å; M36-I41 HydrophobicContact CE-CG2 4.45Å; M36-I41 HydrophobicContact SD-CG2 3.86Å; M36-V109 HydrophobicContact CB-CG1 4.45Å; M36-V109 HydrophobicContact CB-CG2 3.92Å; M36-V109 HydrophobicContact CE-CG2 3.23Å; M36-V109 HydrophobicContact CG-CG2 4.05Å; M36-V109 HydrophobicContact SD-CG2 4.41Å
37	R	57.7	Low	59.2	Low	179 Å²	179	79.3 Å²	79.3	68%	0.675	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-23.7	166	-61.1	173.4	-165.4	-159.1	0.4	112.3	D35 P39	D35-R37 PolarHBondContact O-N 2.8Å; D35-R37 WeakPolarHBondContact OD1-CB 3.32Å; D35-R37 WeakPolarHBondContact OD1-CD 3.44Å; D35-R37 WeakPolarHBondContact OD1-CG 3.49Å; D35-R37 PolarHBondContact OD1-N 3.31Å; D35-R37 IonicContact OD1-NE 3.99Å; R37-P39 VanDerWaalsContact O-CD 3.22Å; R37-P39 WeakPolarHBondContact O-CD 3.24Å
38	N	66.4	Low	60.6	Low	79 Å²	79	78.4 Å²	78.4	42%	0.422	45%	0.446	S	S	.	.			trans	-72.1	112.4	178.9	-171.2	-15.4	0	0	0	109.7	D35 A40 I41	D35-N38 WeakPolarHBondContact O-CB 3.36Å; D35-N38 PolarHBondContact O-N 2.98Å; N38-A40 PolarHBondContact O-N 2.86Å; N38-A40 VanDerWaalsContact O-N 3.08Å; N38-A40 VanDerWaalsContact OD1-CB 3.23Å; N38-A40 WeakPolarHBondContact OD1-CB 3.39Å; N38-A40 PolarHBondContact OD1-N 3.39Å; N38-I41 HydrophobicContact CB-CD1 4.01Å; N38-I41 HydrophobicContact CB-CG1 4.1Å; N38-I41 PolarHBondContact O-N 3.43Å
39	P	64.1	Low	62	Low	92 Å²	92	76.7 Å²	76.7	60%	0.597	43%	0.432	S	S	*	.	H	α-helix	trans	-58.6	-25.7	-179.8	25.4	-35	0	0	0	112.5	R37 I41 F42 V43	R37-P39 VanDerWaalsContact O-CD 3.22Å; R37-P39 WeakPolarHBondContact O-CD 3.24Å; P39-I41 VanDerWaalsContact C-N 3.28Å; P39-I41 PolarHBondContact O-N 3.11Å; P39-F42 PolarHBondContact O-N 3.43Å; P39-V43 WeakPolarHBondContact O-CG2 3.33Å; P39-V43 PolarHBondContact O-N 2.89Å
40	A	71.8	Confident	63.2	Low	52 Å²	52	76.9 Å²	76.9	43%	0.43	43%	0.428	S	S	.	.	H	α-helix	trans	-60.8	-36.6	176	0	0	0	0	0	112.6	N38 T44	N38-A40 PolarHBondContact O-N 2.86Å; N38-A40 VanDerWaalsContact O-N 3.08Å; N38-A40 VanDerWaalsContact OD1-CB 3.23Å; N38-A40 WeakPolarHBondContact OD1-CB 3.39Å; N38-A40 PolarHBondContact OD1-N 3.39Å; A40-T44 WeakPolarHBondContact O-CB 3.43Å; A40-T44 PolarHBondContact O-N 2.79Å; A40-T44 PolarHBondContact O-OG1 2.96Å
41	I	68.8	Low	64.3	Low	37 Å²	37	75.7 Å²	75.7	19%	0.19	42%	0.42	C	S	.	.	H	α-helix	trans	-69.1	-44.4	178.2	-59.2	175.3	0	0	0	109.7	A34 D35 M36 N38 P39 V43 T44 M45	A34-I41 HydrophobicContact CB-CD1 3.94Å; D35-I41 WeakPolarHBondContact O-CD1 3.42Å; M36-I41 HydrophobicContact CE-CG2 4.45Å; M36-I41 HydrophobicContact SD-CG2 3.86Å; N38-I41 HydrophobicContact CB-CD1 4.01Å; N38-I41 HydrophobicContact CB-CG1 4.1Å; N38-I41 PolarHBondContact O-N 3.43Å; P39-I41 VanDerWaalsContact C-N 3.28Å; P39-I41 PolarHBondContact O-N 3.11Å; I41-V43 PolarHBondContact O-N 2.74Å; I41-T44 PolarHBondContact O-N 3.16Å; I41-M45 HydrophobicContact CG2-CG 4.44Å; I41-M45 WeakPolarHBondContact O-CG 3.31Å; I41-M45 PolarHBondContact O-N 2.9Å
42	F	67.6	Low	65.2	Low	74 Å²	74	73.5 Å²	73.5	33%	0.325	41%	0.409	S	S	.	.	H	α-helix	trans	-58.9	-46.3	176.1	-177.2	-90.8	0	0	0	111.7	P39 T44 M45 A46 L106 V109	P39-F42 PolarHBondContact O-N 3.43Å; F42-T44 VanDerWaalsContact C-N 3.32Å; F42-T44 PolarHBondContact O-N 3.39Å; F42-M45 PolarHBondContact O-N 2.95Å; F42-A46 WeakPolarHBondContact O-CB 3.39Å; F42-A46 PolarHBondContact O-N 2.8Å; F42-L106 HydrophobicContact CD2-CD2 3.57Å; F42-L106 HydrophobicContact CE2-CD2 3.69Å; F42-L106 HydrophobicContact CG-CD2 4.32Å; F42-V109 HydrophobicContact CD2-CG1 4.13Å
43	V	71.2	Confident	66.2	Low	85 Å²	85	70.3 Å²	70.3	52%	0.515	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-43	176.3	172.7	0	0	0	0	110.6	P39 I41 M45 A46 T47	P39-V43 WeakPolarHBondContact O-CG2 3.33Å; P39-V43 PolarHBondContact O-N 2.89Å; I41-V43 PolarHBondContact O-N 2.74Å; V43-M45 PolarHBondContact O-N 2.88Å; V43-A46 PolarHBondContact O-N 3.31Å; V43-T47 WeakPolarHBondContact O-CB 3.46Å; V43-T47 PolarHBondContact O-N 3.43Å; V43-T47 PolarHBondContact O-OG1 2.91Å
44	T	74.9	Confident	67	Low	76 Å²	76	69.1 Å²	69.1	47%	0.466	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-43.3	179.1	-56.3	0	0	0	0	111.3	A40 I41 F42 T47 I48	A40-T44 WeakPolarHBondContact O-CB 3.43Å; A40-T44 PolarHBondContact O-N 2.79Å; A40-T44 PolarHBondContact O-OG1 2.96Å; I41-T44 PolarHBondContact O-N 3.16Å; F42-T44 VanDerWaalsContact C-N 3.32Å; F42-T44 PolarHBondContact O-N 3.39Å; T44-T47 PolarHBondContact O-N 3.3Å; T44-I48 HydrophobicContact CG2-CD1 4.02Å; T44-I48 VanDerWaalsContact O-CG1 3.24Å; T44-I48 WeakPolarHBondContact O-CG1 3.49Å; T44-I48 PolarHBondContact O-N 2.94Å
45	M	69.5	Low	67.5	Low	23 Å²	23	71.3 Å²	71.3	11%	0.113	39%	0.385	C	S	.	.	H	α-helix	trans	-66.3	-41.2	177.1	-68.6	-58.9	159	0	0	112.5	I31 I41 F42 V43 T47 I48 L49 V102 L106	I31-M45 HydrophobicContact CD1-CE 3.83Å; I41-M45 HydrophobicContact CG2-CG 4.44Å; I41-M45 WeakPolarHBondContact O-CG 3.31Å; I41-M45 PolarHBondContact O-N 2.9Å; F42-M45 PolarHBondContact O-N 2.95Å; V43-M45 PolarHBondContact O-N 2.88Å; M45-T47 PolarHBondContact O-N 3.49Å; M45-I48 PolarHBondContact O-N 3.29Å; M45-I48 HydrophobicContact SD-CD1 4.09Å; M45-L49 PolarHBondContact O-N 3.3Å; M45-V102 HydrophobicContact CB-CG1 4.03Å; M45-V102 HydrophobicContact SD-CG1 3.99Å; M45-L106 HydrophobicContact CB-CD1 4.46Å; M45-L106 HydrophobicContact CB-CD2 3.63Å; M45-L106 HydrophobicContact CB-CG 4.12Å
46	A	70.7	Confident	67.6	Low	39 Å²	39	68.4 Å²	68.4	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-41.9	174	0	0	0	0	0	111.9	F42 V43 L49 L50	F42-A46 WeakPolarHBondContact O-CB 3.39Å; F42-A46 PolarHBondContact O-N 2.8Å; V43-A46 PolarHBondContact O-N 3.31Å; A46-L49 PolarHBondContact O-N 2.92Å; A46-L50 PolarHBondContact O-N 2.81Å
47	T	71.2	Confident	67.6	Low	75 Å²	75	68.6 Å²	68.6	46%	0.46	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-41.5	174.6	-56.8	0	0	0	0	111.3	V43 T44 M45 L49 L50 T51	V43-T47 WeakPolarHBondContact O-CB 3.46Å; V43-T47 PolarHBondContact O-N 3.43Å; V43-T47 PolarHBondContact O-OG1 2.91Å; T44-T47 PolarHBondContact O-N 3.3Å; M45-T47 PolarHBondContact O-N 3.49Å; T47-L49 VanDerWaalsContact C-N 3.34Å; T47-L49 PolarHBondContact O-N 3.5Å; T47-L50 PolarHBondContact O-N 3.46Å; T47-T51 PolarHBondContact O-N 3.06Å; T47-T51 PolarHBondContact O-OG1 2.8Å
48	I	75.4	Confident	67.2	Low	65 Å²	65	66.2 Å²	66.2	33%	0.333	37%	0.373	S	S	.	.	H	α-helix	trans	-59.6	-45	174.7	-71.3	163.9	0	0	0	110.5	T44 M45 L50 T51 I52 V102	T44-I48 HydrophobicContact CG2-CD1 4.02Å; T44-I48 VanDerWaalsContact O-CG1 3.24Å; T44-I48 WeakPolarHBondContact O-CG1 3.49Å; T44-I48 PolarHBondContact O-N 2.94Å; M45-I48 PolarHBondContact O-N 3.29Å; M45-I48 HydrophobicContact SD-CD1 4.09Å; I48-L50 VanDerWaalsContact C-N 3.35Å; I48-L50 PolarHBondContact O-N 2.83Å; I48-T51 PolarHBondContact O-N 3.15Å; I48-I52 HydrophobicContact CG2-CD1 3.6Å; I48-I52 HydrophobicContact CG2-CG1 4.33Å; I48-I52 WeakPolarHBondContact O-CB 3.22Å; I48-I52 WeakPolarHBondContact O-CD1 3.44Å; I48-I52 WeakPolarHBondContact O-CG1 3.49Å; I48-I52 PolarHBondContact O-N 3.06Å; I48-V102 HydrophobicContact CG2-CG2 4.45Å
49	L	73.4	Confident	66.4	Low	20 Å²	20	68 Å²	68	11%	0.105	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-42.5	175.3	-73.9	-179	0	0	0	112.6	M45 A46 T47 I52 F53 F99 V102 L106	M45-L49 PolarHBondContact O-N 3.3Å; A46-L49 PolarHBondContact O-N 2.92Å; T47-L49 VanDerWaalsContact C-N 3.34Å; T47-L49 PolarHBondContact O-N 3.5Å; L49-I52 PolarHBondContact O-N 2.79Å; L49-F53 WeakPolarHBondContact O-CB 3.22Å; L49-F53 PolarHBondContact O-N 3.32Å; L49-F99 HydrophobicContact CD2-CD2 3.58Å; L49-F99 HydrophobicContact CD2-CE2 3.81Å; L49-F99 HydrophobicContact CD2-CG 4.17Å; L49-V102 HydrophobicContact CD1-CG1 4.17Å; L49-V102 HydrophobicContact CD2-CB 3.65Å; L49-V102 HydrophobicContact CD2-CG1 3.69Å; L49-V102 HydrophobicContact CG-CB 4.16Å; L49-V102 HydrophobicContact CG-CG1 3.59Å; L49-L106 HydrophobicContact CD1-CD1 3.3Å; L49-L106 HydrophobicContact CD1-CG 4.38Å; L49-L106 HydrophobicContact CG-CD1 4.33Å
50	L	74.5	Confident	65.6	Low	102 Å²	102	66.6 Å²	66.6	53%	0.534	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-44.7	178.3	-175.2	65.3	0	0	0	111.3	A46 T47 I48 F53 N54	A46-L50 PolarHBondContact O-N 2.81Å; T47-L50 PolarHBondContact O-N 3.46Å; I48-L50 VanDerWaalsContact C-N 3.35Å; I48-L50 PolarHBondContact O-N 2.83Å; L50-F53 PolarHBondContact O-N 2.96Å; L50-N54 WeakPolarHBondContact O-CB 3.18Å; L50-N54 PolarHBondContact O-N 3.36Å
51	T	69.1	Low	64.2	Low	71 Å²	71	70.2 Å²	70.2	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-61.3	-45.4	175.3	-56.7	0	0	0	0	110.9	T47 I48 F53 N54 D55	T47-T51 PolarHBondContact O-N 3.06Å; T47-T51 PolarHBondContact O-OG1 2.8Å; I48-T51 PolarHBondContact O-N 3.15Å; T51-F53 VanDerWaalsContact C-N 3.31Å; T51-F53 PolarHBondContact O-N 2.86Å; T51-N54 PolarHBondContact O-N 3.07Å; T51-D55 WeakPolarHBondContact O-CB 3.42Å; T51-D55 PolarHBondContact O-N 3.05Å
52	I	66.5	Low	63.1	Low	16 Å²	16	73 Å²	73	8%	0.082	41%	0.41	C	S	.	.	H	α-helix	trans	-60	-43.1	175.9	-69.8	165.1	0	0	0	110.5	I48 L49 D55 F56 L98 F99	I48-I52 HydrophobicContact CG2-CD1 3.6Å; I48-I52 HydrophobicContact CG2-CG1 4.33Å; I48-I52 WeakPolarHBondContact O-CB 3.22Å; I48-I52 WeakPolarHBondContact O-CD1 3.44Å; I48-I52 WeakPolarHBondContact O-CG1 3.49Å; I48-I52 PolarHBondContact O-N 3.06Å; L49-I52 PolarHBondContact O-N 2.79Å; I52-D55 PolarHBondContact O-N 2.98Å; I52-F56 HydrophobicContact CG2-CD2 3.49Å; I52-F56 VanDerWaalsContact CG2-CD2 3.49Å; I52-F56 HydrophobicContact CG2-CE2 3.66Å; I52-F56 VanDerWaalsContact O-CB 3.27Å; I52-F56 WeakPolarHBondContact O-CB 2.93Å; I52-F56 WeakPolarHBondContact O-CD2 3.33Å; I52-F56 PolarHBondContact O-N 2.66Å; I52-L98 HydrophobicContact CD1-CD2 3.72Å; I52-L98 HydrophobicContact CD1-CG 3.81Å; I52-L98 HydrophobicContact CG1-CD2 4.39Å; I52-F99 HydrophobicContact CG2-CB 4.01Å; I52-F99 HydrophobicContact CG2-CD2 4.15Å
53	F	67.8	Low	62	Low	117 Å²	117	74.1 Å²	74.1	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-66.6	-39.6	178.7	-172.1	-95.1	0	0	0	112.7	L49 L50 T51 F56 S57	L49-F53 WeakPolarHBondContact O-CB 3.22Å; L49-F53 PolarHBondContact O-N 3.32Å; L50-F53 PolarHBondContact O-N 2.96Å; T51-F53 VanDerWaalsContact C-N 3.31Å; T51-F53 PolarHBondContact O-N 2.86Å; F53-F56 PolarHBondContact O-N 2.72Å; F53-S57 VanDerWaalsContact CE1-OG 3.3Å; F53-S57 WeakPolarHBondContact CE1-OG 3.28Å; F53-S57 WeakPolarHBondContact O-CB 3.26Å; F53-S57 PolarHBondContact O-N 2.97Å; F53-S57 PolarHBondContact O-OG 2.97Å
54	N	65.4	Low	60.8	Low	80 Å²	80	79 Å²	79	43%	0.428	43%	0.434	S	S	.	.	H	α-helix	trans	-63.4	-48.5	173.6	-76.7	-14.2	0	0	0	110.8	L50 T51 F56 S57 I58	L50-N54 WeakPolarHBondContact O-CB 3.18Å; L50-N54 PolarHBondContact O-N 3.36Å; T51-N54 PolarHBondContact O-N 3.07Å; N54-F56 PolarHBondContact O-N 3.35Å; N54-S57 PolarHBondContact O-N 3.36Å; N54-I58 WeakPolarHBondContact O-CD1 3.08Å; N54-I58 VanDerWaalsContact O-CG1 3.25Å; N54-I58 WeakPolarHBondContact O-CG1 3.23Å; N54-I58 PolarHBondContact O-N 3.36Å; N54-I58 VanDerWaalsContact O-N 3.11Å
55	D	62	Low	59.4	Low	81 Å²	81	82.6 Å²	82.6	43%	0.433	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-25.8	176.6	-74.3	-4.3	0	0	0	112.6	T51 I52 D59 K95	T51-D55 WeakPolarHBondContact O-CB 3.42Å; T51-D55 PolarHBondContact O-N 3.05Å; I52-D55 PolarHBondContact O-N 2.98Å; D55-D59 PolarHBondContact O-N 2.89Å; D55-K95 PolarHBondContact O-NZ 2.94Å
56	F	56.6	Low	58.3	Low	32 Å²	32	89 Å²	89	14%	0.14	48%	0.477	C	S	.	.	H	α-helix	trans	-79.9	-44.3	174.2	-101	-62.8	0	0	0	113.3	I52 F53 N54 I58 D59 A60 S92 K95 R96	I52-F56 HydrophobicContact CG2-CD2 3.49Å; I52-F56 VanDerWaalsContact CG2-CD2 3.49Å; I52-F56 HydrophobicContact CG2-CE2 3.66Å; I52-F56 VanDerWaalsContact O-CB 3.27Å; I52-F56 WeakPolarHBondContact O-CB 2.93Å; I52-F56 WeakPolarHBondContact O-CD2 3.33Å; I52-F56 PolarHBondContact O-N 2.66Å; F53-F56 PolarHBondContact O-N 2.72Å; N54-F56 PolarHBondContact O-N 3.35Å; F56-I58 PolarHBondContact O-N 3.49Å; F56-D59 PolarHBondContact O-N 3.31Å; F56-A60 WeakPolarHBondContact O-CB 3.05Å; F56-A60 PolarHBondContact O-N 3.32Å; F56-S92 VanDerWaalsContact CZ-O 3.26Å; F56-S92 WeakPolarHBondContact CZ-O 3.37Å; F56-K95 HydrophobicContact CD1-CD 4.47Å; F56-K95 HydrophobicContact CD2-CB 4.05Å; F56-K95 HydrophobicContact CE1-CB 3.83Å; F56-K95 HydrophobicContact CE1-CD 4.31Å; F56-K95 HydrophobicContact CE2-CB 3.22Å; F56-K95 HydrophobicContact CE2-CD 4.44Å; F56-K95 HydrophobicContact CE2-CG 4.39Å; F56-K95 WeakPolarHBondContact CE2-O 3.46Å; F56-K95 HydrophobicContact CZ-CB 3.1Å; F56-K95 HydrophobicContact CZ-CD 4.33Å; F56-K95 HydrophobicContact CZ-CG 4.33Å; F56-R96 HydrophobicContact CZ-CB 3.83Å
57	S	55.8	Low	57	Low	45 Å²	45	91.9 Å²	91.9	32%	0.315	50%	0.495	S	S	.	.	H	α-helix	trans	-64.6	-31.6	-178.2	-61.7	0	0	0	0	110.6	F53 N54 L61	F53-S57 VanDerWaalsContact CE1-OG 3.3Å; F53-S57 WeakPolarHBondContact CE1-OG 3.28Å; F53-S57 WeakPolarHBondContact O-CB 3.26Å; F53-S57 PolarHBondContact O-N 2.97Å; F53-S57 PolarHBondContact O-OG 2.97Å; N54-S57 PolarHBondContact O-N 3.36Å; S57-L61 WeakPolarHBondContact O-CD1 3.36Å
58	I	47.6	Very low	55.7	Low	130 Å²	130	96 Å²	96	67%	0.667	51%	0.513	S	S	*	.	H	α-helix	trans	-78	-41.5	178.3	-61.3	166.4	0	0	0	111.7	N54 F56	N54-I58 WeakPolarHBondContact O-CD1 3.08Å; N54-I58 VanDerWaalsContact O-CG1 3.25Å; N54-I58 WeakPolarHBondContact O-CG1 3.23Å; N54-I58 PolarHBondContact O-N 3.36Å; N54-I58 VanDerWaalsContact O-N 3.11Å; F56-I58 PolarHBondContact O-N 3.49Å
59	D	51.4	Low	54.2	Low	117 Å²	117	98.5 Å²	98.5	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-84.8	-23.1	-177.9	-78	-18.4	0	0	0	114.2	D55 F56 K95	D55-D59 PolarHBondContact O-N 2.89Å; F56-D59 PolarHBondContact O-N 3.31Å; D59-K95 IonicContact OD2-NZ 2.68Å; D59-K95 PolarHBondContact OD2-NZ 3.31Å
60	A	47.3	Very low	52.7	Low	61 Å²	61	103.5 Å²	103.5	50%	0.504	57%	0.566	S	S	.	*	S	Bend	trans	-95.5	-5.4	-174.3	0	0	0	0	0	114.3	F56 P62	F56-A60 WeakPolarHBondContact O-CB 3.05Å; F56-A60 PolarHBondContact O-N 3.32Å; A60-P62 WeakPolarHBondContact O-CD 3.23Å
61	L	41.6	Very low	51.1	Low	129 Å²	129	104.4 Å²	104.4	68%	0.675	57%	0.571	S	S	*	*	S	Bend	trans	-80.2	102.1	162.1	-79.2	162.2	0	0	0	106.6	S57 D63	S57-L61 WeakPolarHBondContact O-CD1 3.36Å; L61-D63 PolarHBondContact O-N 2.9Å
62	P	44.9	Very low	50.3	Low	95 Å²	95	108 Å²	108	62%	0.617	59%	0.588	S	S	*	*			trans	-55.8	117.7	157.1	25.4	-31.1	0	0	0	105.3	A60 K64	A60-P62 WeakPolarHBondContact O-CD 3.23Å; P62-K64 PolarHBondContact O-N 2.68Å
63	D	44.7	Very low	49.4	Very low	97 Å²	97	114.4 Å²	114.4	52%	0.519	62%	0.617	S	S	.	*			trans	-54.2	86.3	162.5	-93.4	-25.1	0	0	0	106	L61 D65 K66	L61-D63 PolarHBondContact O-N 2.9Å; D63-D65 PolarHBondContact O-N 2.64Å; D63-K66 HydrophobicContact CB-CB 4.18Å; D63-K66 HydrophobicContact CB-CD 4.16Å; D63-K66 HydrophobicContact CB-CG 4.1Å; D63-K66 PolarHBondContact O-N 3.21Å; D63-K66 WeakPolarHBondContact OD2-CD 3.49Å; D63-K66 VanDerWaalsContact OD2-CE 3.23Å; D63-K66 WeakPolarHBondContact OD2-CE 3.42Å; D63-K66 IonicContact OD2-NZ 2.72Å; D63-K66 PolarHBondContact OD2-NZ 2.75Å
64	K	47.4	Very low	48.8	Very low	189 Å²	189	114.3 Å²	114.3	82%	0.822	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-7.5	174.2	-83.2	-159.7	174.7	-173.7	0	111.2	P62	P62-K64 PolarHBondContact O-N 2.68Å
65	D	45.5	Very low	48.1	Very low	151 Å²	151	113.1 Å²	113.1	81%	0.807	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-1.2	-177.5	-60.9	-27.7	0	0	0	114.3	D63 S67	D63-D65 PolarHBondContact O-N 2.64Å; D65-S67 PolarHBondContact O-N 3.43Å
66	K	46.3	Very low	47.5	Very low	157 Å²	157	112.6 Å²	112.6	68%	0.683	63%	0.632	S	S	*	*	S	Bend	trans	-82.7	79.9	166.2	-79	179.5	-177.8	145.4	0	109.5	D63	D63-K66 HydrophobicContact CB-CB 4.18Å; D63-K66 HydrophobicContact CB-CD 4.16Å; D63-K66 HydrophobicContact CB-CG 4.1Å; D63-K66 PolarHBondContact O-N 3.21Å; D63-K66 WeakPolarHBondContact OD2-CD 3.49Å; D63-K66 VanDerWaalsContact OD2-CE 3.23Å; D63-K66 WeakPolarHBondContact OD2-CE 3.42Å; D63-K66 IonicContact OD2-NZ 2.72Å; D63-K66 PolarHBondContact OD2-NZ 2.75Å
67	S	43.3	Very low	47.3	Very low	100 Å²	100	116.4 Å²	116.4	70%	0.699	65%	0.65	S	S	*	*			trans	15.1	110.7	149.1	47.4	0	0	0	0	115.1	D65 P69	D65-S67 PolarHBondContact O-N 3.43Å; S67-P69 VanDerWaalsContact O-CD 3.31Å; S67-P69 WeakPolarHBondContact O-CD 3.26Å; S67-P69 VanDerWaalsContact O-N 3.17Å
68	L	43	Very low	47.1	Very low	160 Å²	160	119.6 Å²	119.6	84%	0.838	66%	0.658	S	S	*	*			trans	-47.1	122.2	162.1	-77.4	96.1	0	0	0	109.4	T70	L68-T70 PolarHBondContact O-N 2.8Å
69	P	44.4	Very low	47.4	Very low	118 Å²	118	119.4 Å²	119.4	77%	0.766	66%	0.656	S	S	*	*			trans	-67.4	106.2	165.3	24.3	-28.4	0	0	0	108	S67 N71	S67-P69 VanDerWaalsContact O-CD 3.31Å; S67-P69 WeakPolarHBondContact O-CD 3.26Å; S67-P69 VanDerWaalsContact O-N 3.17Å; P69-N71 PolarHBondContact O-N 3.28Å
70	T	42.2	Very low	47.4	Very low	126 Å²	126	119.2 Å²	119.2	77%	0.773	66%	0.655	S	S	*	*			trans	-57.5	119	165.6	45.6	0	0	0	0	108.9	L68	L68-T70 PolarHBondContact O-N 2.8Å
71	N	40.8	Very low	47.9	Very low	121 Å²	121	119.3 Å²	119.3	65%	0.647	65%	0.651	S	S	*	*	S	Bend	trans	44.6	101.2	153.5	-68	-17.6	0	0	0	118	P69	P69-N71 PolarHBondContact O-N 3.28Å
72	N	51.1	Low	48.5	Very low	147 Å²	147	118 Å²	118	79%	0.786	65%	0.645	S	S	*	*	S	Bend		167.6	7.6	105.5	-90.7	-11.1	0	0	0	117.6
73	E	49.1	Very low	48.9	Very low	149 Å²	149	119.5 Å²	119.5	70%	0.696	64%	0.643	S	S	*	*			trans	-120.5	55.3	178.8	-60.4	-166.8	-176.8	0	0	113.3	G75	E73-G75 PolarHBondContact O-N 3.39Å; E73-G75 VanDerWaalsContact O-N 3.15Å
74	Q	54.6	Low	49.5	Very low	115 Å²	115	118.7 Å²	118.7	54%	0.537	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.3	8.5	-160.9	-69.7	-175.4	3.2	0	0	117.9	K78	Q74-K78 WeakPolarHBondContact O-CD 3.27Å
75	G	49.5	Very low	50	Low	55 Å²	55	112.4 Å²	112.4	57%	0.567	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-62.5	-177.1	0	0	0	0	0	114.2	E73	E73-G75 PolarHBondContact O-N 3.39Å; E73-G75 VanDerWaalsContact O-N 3.15Å
76	A	51.2	Low	50.7	Low	71 Å²	71	112.1 Å²	112.1	59%	0.587	61%	0.613	S	S	*	*	H	α-helix	trans	-78.3	-39.1	-172.9	0	0	0	0	0	112.5	K78 M79 L80	A76-K78 PolarHBondContact O-N 2.88Å; A76-M79 PolarHBondContact O-N 3.33Å; A76-M79 VanDerWaalsContact O-N 3.16Å; A76-L80 PolarHBondContact O-N 3.34Å
77	E	51.3	Low	51.4	Low	112 Å²	112	110 Å²	110	52%	0.523	61%	0.606	S	S	.	*	H	α-helix	trans	-67.3	-35.1	-179.7	-63.6	-165.6	152.4	0	0	112.5	M79 L80 S81	E77-M79 VanDerWaalsContact C-N 3.3Å; E77-M79 PolarHBondContact O-N 2.88Å; E77-L80 PolarHBondContact O-N 3.48Å; E77-S81 WeakPolarHBondContact O-CB 3.4Å; E77-S81 PolarHBondContact O-N 3.11Å; E77-S81 PolarHBondContact O-OG 3.36Å
78	K	52.2	Low	52.3	Low	112 Å²	112	108 Å²	108	49%	0.487	60%	0.595	S	S	.	*	H	α-helix	trans	-63.8	-34.7	172.9	-74.8	-171.6	-173.9	169.9	0	112.1	Q74 A76 S81 L82	Q74-K78 WeakPolarHBondContact O-CD 3.27Å; A76-K78 PolarHBondContact O-N 2.88Å; K78-S81 WeakPolarHBondContact CA-OG 3.27Å; K78-S81 PolarHBondContact O-OG 3.43Å; K78-S81 VanDerWaalsContact O-OG 3.07Å; K78-L82 WeakPolarHBondContact O-CB 3.45Å; K78-L82 WeakPolarHBondContact O-CD1 3.4Å; K78-L82 WeakPolarHBondContact O-CG 3.41Å; K78-L82 PolarHBondContact O-N 3.06Å
79	M	52.7	Low	53.4	Low	126 Å²	126	103.2 Å²	103.2	62%	0.621	58%	0.579	S	S	*	*	H	α-helix	trans	-72.1	-40	175.3	-83.3	-176.2	45.4	0	0	112.3	A76 E77 L82 Q83	A76-M79 PolarHBondContact O-N 3.33Å; A76-M79 VanDerWaalsContact O-N 3.16Å; E77-M79 VanDerWaalsContact C-N 3.3Å; E77-M79 PolarHBondContact O-N 2.88Å; M79-L82 PolarHBondContact O-N 3.04Å; M79-Q83 WeakPolarHBondContact O-CG 3.43Å; M79-Q83 PolarHBondContact O-N 2.85Å
80	L	52.7	Low	54.5	Low	113 Å²	113	104 Å²	104	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-64.3	-44.4	174.5	-106.3	143.6	0	0	0	111.2	A76 E77 L82 Q83 T84	A76-L80 PolarHBondContact O-N 3.34Å; E77-L80 PolarHBondContact O-N 3.48Å; L80-L82 VanDerWaalsContact C-N 3.34Å; L80-L82 PolarHBondContact O-N 3.43Å; L80-Q83 PolarHBondContact O-N 3.44Å; L80-T84 WeakPolarHBondContact O-CG2 3.46Å; L80-T84 PolarHBondContact O-N 3.25Å; L80-T84 PolarHBondContact O-OG1 3.46Å
81	S	56.8	Low	55.7	Low	62 Å²	62	101.1 Å²	101.1	43%	0.434	55%	0.553	S	S	.	*	H	α-helix	trans	-66.2	-33.2	177.3	71.3	0	0	0	0	113.1	E77 K78 T84 S85	E77-S81 WeakPolarHBondContact O-CB 3.4Å; E77-S81 PolarHBondContact O-N 3.11Å; E77-S81 PolarHBondContact O-OG 3.36Å; K78-S81 WeakPolarHBondContact CA-OG 3.27Å; K78-S81 PolarHBondContact O-OG 3.43Å; K78-S81 VanDerWaalsContact O-OG 3.07Å; S81-T84 WeakPolarHBondContact CA-OG1 3.18Å; S81-T84 PolarHBondContact O-OG1 3.37Å; S81-T84 VanDerWaalsContact O-OG1 3.11Å; S81-S85 VanDerWaalsContact O-CB 3.24Å; S81-S85 WeakPolarHBondContact O-CB 3.4Å; S81-S85 PolarHBondContact O-N 2.95Å; S81-S85 PolarHBondContact O-OG 3.02Å
82	L	54.1	Low	57.1	Low	102 Å²	102	97.8 Å²	97.8	53%	0.534	54%	0.539	S	S	.	.	H	α-helix	trans	-71.3	-34.5	172.5	-74.3	172.3	0	0	0	112.8	K78 M79 L80 S85 K86	K78-L82 WeakPolarHBondContact O-CB 3.45Å; K78-L82 WeakPolarHBondContact O-CD1 3.4Å; K78-L82 WeakPolarHBondContact O-CG 3.41Å; K78-L82 PolarHBondContact O-N 3.06Å; M79-L82 PolarHBondContact O-N 3.04Å; L80-L82 VanDerWaalsContact C-N 3.34Å; L80-L82 PolarHBondContact O-N 3.43Å; L82-S85 VanDerWaalsContact CA-OG 3.32Å; L82-S85 WeakPolarHBondContact CA-OG 3.23Å; L82-S85 PolarHBondContact O-OG 3.33Å; L82-S85 VanDerWaalsContact O-OG 3.07Å; L82-K86 WeakPolarHBondContact O-CB 3.21Å; L82-K86 VanDerWaalsContact O-CG 3.29Å; L82-K86 WeakPolarHBondContact O-CG 3.3Å; L82-K86 PolarHBondContact O-N 3.49Å; L82-K86 VanDerWaalsContact O-N 3.08Å
83	Q	54.3	Low	58.3	Low	126 Å²	126	98.9 Å²	98.9	59%	0.589	54%	0.536	S	S	*	.	H	α-helix	trans	-71.8	-43.6	175	-77.9	-174.1	9.6	0	0	111.8	M79 L80 K86 Q87	M79-Q83 WeakPolarHBondContact O-CG 3.43Å; M79-Q83 PolarHBondContact O-N 2.85Å; L80-Q83 PolarHBondContact O-N 3.44Å; Q83-K86 PolarHBondContact O-N 3.24Å; Q83-Q87 WeakPolarHBondContact O-CB 3.34Å; Q83-Q87 PolarHBondContact O-N 2.84Å
84	T	56.5	Low	59.5	Low	80 Å²	80	94.3 Å²	94.3	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-39.8	177	56.8	0	0	0	0	111.4	L80 S81 Q87 A88	L80-T84 WeakPolarHBondContact O-CG2 3.46Å; L80-T84 PolarHBondContact O-N 3.25Å; L80-T84 PolarHBondContact O-OG1 3.46Å; S81-T84 WeakPolarHBondContact CA-OG1 3.18Å; S81-T84 PolarHBondContact O-OG1 3.37Å; S81-T84 VanDerWaalsContact O-OG1 3.11Å; T84-Q87 PolarHBondContact O-N 3.31Å; T84-A88 VanDerWaalsContact O-CB 3.22Å; T84-A88 WeakPolarHBondContact O-CB 3.48Å; T84-A88 PolarHBondContact O-N 2.88Å
85	S	59.1	Low	60.2	Low	58 Å²	58	91.2 Å²	91.2	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-38.6	175.3	57.9	0	0	0	0	113.1	S81 L82 A88 A89	S81-S85 VanDerWaalsContact O-CB 3.24Å; S81-S85 WeakPolarHBondContact O-CB 3.4Å; S81-S85 PolarHBondContact O-N 2.95Å; S81-S85 PolarHBondContact O-OG 3.02Å; L82-S85 VanDerWaalsContact CA-OG 3.32Å; L82-S85 WeakPolarHBondContact CA-OG 3.23Å; L82-S85 PolarHBondContact O-OG 3.33Å; L82-S85 VanDerWaalsContact O-OG 3.07Å; S85-A88 PolarHBondContact O-N 3.28Å; S85-A89 WeakPolarHBondContact O-CB 3.42Å; S85-A89 PolarHBondContact O-N 2.93Å
86	K	59.1	Low	61.5	Low	144 Å²	144	97 Å²	97	63%	0.626	51%	0.513	S	S	*	.	H	α-helix	trans	-63.9	-44.2	172.9	-78.6	179	-177.1	-178.9	0	111.8	L82 Q83 A89 E90	L82-K86 WeakPolarHBondContact O-CB 3.21Å; L82-K86 VanDerWaalsContact O-CG 3.29Å; L82-K86 WeakPolarHBondContact O-CG 3.3Å; L82-K86 PolarHBondContact O-N 3.49Å; L82-K86 VanDerWaalsContact O-N 3.08Å; Q83-K86 PolarHBondContact O-N 3.24Å; K86-A89 PolarHBondContact O-N 3.34Å; K86-E90 WeakPolarHBondContact O-CG 3.36Å; K86-E90 PolarHBondContact O-N 3.47Å
87	Q	61.9	Low	62.7	Low	112 Å²	112	97.1 Å²	97.1	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-38.1	177.4	-168.3	171.9	2.9	0	0	111.6	Q83 T84 E90 N91	Q83-Q87 WeakPolarHBondContact O-CB 3.34Å; Q83-Q87 PolarHBondContact O-N 2.84Å; T84-Q87 PolarHBondContact O-N 3.31Å; Q87-E90 PolarHBondContact O-N 2.95Å; Q87-N91 VanDerWaalsContact O-CB 3.23Å; Q87-N91 WeakPolarHBondContact O-CB 3.49Å; Q87-N91 PolarHBondContact O-N 3.5Å; Q87-N91 PolarHBondContact O-ND2 2.96Å
88	A	62.1	Low	64	Low	58 Å²	58	93.9 Å²	93.9	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-41.1	173	0	0	0	0	0	111.7	T84 S85 N91 S92	T84-A88 VanDerWaalsContact O-CB 3.22Å; T84-A88 WeakPolarHBondContact O-CB 3.48Å; T84-A88 PolarHBondContact O-N 2.88Å; S85-A88 PolarHBondContact O-N 3.28Å; A88-N91 PolarHBondContact O-N 3.3Å; A88-S92 WeakPolarHBondContact O-CB 3.15Å; A88-S92 PolarHBondContact O-N 3.49Å
89	A	65.1	Low	65.2	Low	60 Å²	60	91.3 Å²	91.3	50%	0.496	49%	0.485	S	S	.	.	H	α-helix	trans	-66.2	-42	175.7	0	0	0	0	0	112.3	S85 K86 S92 K93	S85-A89 WeakPolarHBondContact O-CB 3.42Å; S85-A89 PolarHBondContact O-N 2.93Å; K86-A89 PolarHBondContact O-N 3.34Å; A89-S92 PolarHBondContact O-N 3.29Å; A89-K93 WeakPolarHBondContact O-CB 3.44Å; A89-K93 PolarHBondContact O-N 3.24Å
90	E	68.5	Low	66.5	Low	136 Å²	136	89.1 Å²	89.1	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-65.1	-43.9	174.6	-74.7	-177.5	-177.3	0	0	111.8	K86 Q87 K93 A94	K86-E90 WeakPolarHBondContact O-CG 3.36Å; K86-E90 PolarHBondContact O-N 3.47Å; Q87-E90 PolarHBondContact O-N 2.95Å; E90-K93 PolarHBondContact O-N 2.82Å; E90-A94 WeakPolarHBondContact O-CB 3.49Å; E90-A94 PolarHBondContact O-N 3.23Å
91	N	67	Low	67.8	Low	65 Å²	65	86.9 Å²	86.9	35%	0.348	47%	0.466	S	S	.	.	H	α-helix	trans	-62.1	-43.7	175	-74	-15.6	0	0	0	110.7	Q87 A88 K93 A94 K95	Q87-N91 VanDerWaalsContact O-CB 3.23Å; Q87-N91 WeakPolarHBondContact O-CB 3.49Å; Q87-N91 PolarHBondContact O-N 3.5Å; Q87-N91 PolarHBondContact O-ND2 2.96Å; A88-N91 PolarHBondContact O-N 3.3Å; N91-K93 PolarHBondContact O-N 3.41Å; N91-A94 PolarHBondContact O-N 2.95Å; N91-K95 VanDerWaalsContact O-CB 3.28Å; N91-K95 WeakPolarHBondContact O-CB 3.46Å; N91-K95 VanDerWaalsContact O-CG 3.22Å; N91-K95 WeakPolarHBondContact O-CG 3.25Å; N91-K95 PolarHBondContact O-N 3.02Å
92	S	70.9	Confident	68.8	Low	51 Å²	51	84.4 Å²	84.4	36%	0.357	45%	0.448	S	S	.	.	H	α-helix	trans	-60.5	-44.1	175.5	176.1	0	0	0	0	111.5	F56 A88 A89 A94 R96	F56-S92 VanDerWaalsContact CZ-O 3.26Å; F56-S92 WeakPolarHBondContact CZ-O 3.37Å; A88-S92 WeakPolarHBondContact O-CB 3.15Å; A88-S92 PolarHBondContact O-N 3.49Å; A89-S92 PolarHBondContact O-N 3.29Å; S92-A94 PolarHBondContact O-N 3.36Å; S92-R96 VanDerWaalsContact O-CB 3.26Å; S92-R96 WeakPolarHBondContact O-CB 3.43Å; S92-R96 PolarHBondContact O-N 3.46Å
93	K	75.5	Confident	70	Confident	169 Å²	169	84 Å²	84	74%	0.735	44%	0.442	S	S	*	.	H	α-helix	trans	-63.4	-44	175.7	-170.8	177.9	-179.2	179.2	0	112.2	A89 E90 N91 R96 S97	A89-K93 WeakPolarHBondContact O-CB 3.44Å; A89-K93 PolarHBondContact O-N 3.24Å; E90-K93 PolarHBondContact O-N 2.82Å; N91-K93 PolarHBondContact O-N 3.41Å; K93-R96 PolarHBondContact O-N 2.86Å; K93-S97 WeakPolarHBondContact O-CB 3.24Å; K93-S97 PolarHBondContact O-N 3.48Å
94	A	73.4	Confident	71.1	Confident	53 Å²	53	81.9 Å²	81.9	44%	0.438	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-46.8	178.9	0	0	0	0	0	111.8	E90 N91 S92 R96 S97 L98	E90-A94 WeakPolarHBondContact O-CB 3.49Å; E90-A94 PolarHBondContact O-N 3.23Å; N91-A94 PolarHBondContact O-N 2.95Å; S92-A94 PolarHBondContact O-N 3.36Å; A94-R96 PolarHBondContact O-N 3.3Å; A94-S97 PolarHBondContact O-N 3.49Å; A94-L98 PolarHBondContact O-N 3.38Å
95	K	71.1	Confident	72.1	Confident	51 Å²	51	80.5 Å²	80.5	22%	0.222	42%	0.424	C	S	.	.	H	α-helix	trans	-58	-37.5	173.8	-71.3	177.9	172.8	-172.1	0	110.3	D55 F56 D59 N91 L98 F99	D55-K95 PolarHBondContact O-NZ 2.94Å; F56-K95 HydrophobicContact CD1-CD 4.47Å; F56-K95 HydrophobicContact CD2-CB 4.05Å; F56-K95 HydrophobicContact CE1-CB 3.83Å; F56-K95 HydrophobicContact CE1-CD 4.31Å; F56-K95 HydrophobicContact CE2-CB 3.22Å; F56-K95 HydrophobicContact CE2-CD 4.44Å; F56-K95 HydrophobicContact CE2-CG 4.39Å; F56-K95 WeakPolarHBondContact CE2-O 3.46Å; F56-K95 HydrophobicContact CZ-CB 3.1Å; F56-K95 HydrophobicContact CZ-CD 4.33Å; F56-K95 HydrophobicContact CZ-CG 4.33Å; D59-K95 IonicContact OD2-NZ 2.68Å; D59-K95 PolarHBondContact OD2-NZ 3.31Å; N91-K95 VanDerWaalsContact O-CB 3.28Å; N91-K95 WeakPolarHBondContact O-CB 3.46Å; N91-K95 VanDerWaalsContact O-CG 3.22Å; N91-K95 WeakPolarHBondContact O-CG 3.25Å; N91-K95 PolarHBondContact O-N 3.02Å; K95-L98 WeakPolarHBondContact O-CB 3.28Å; K95-L98 PolarHBondContact O-N 2.88Å; K95-F99 PolarHBondContact O-N 3.1Å
96	R	75.2	Confident	72.9	Confident	175 Å²	175	78.7 Å²	78.7	66%	0.66	41%	0.41	S	S	*	.	H	α-helix	trans	-74.2	-41.4	-175.6	-179.4	177.1	177.4	176.4	0.5	109.9	F56 S92 K93 A94 L98 F99 M100	F56-R96 HydrophobicContact CZ-CB 3.83Å; S92-R96 VanDerWaalsContact O-CB 3.26Å; S92-R96 WeakPolarHBondContact O-CB 3.43Å; S92-R96 PolarHBondContact O-N 3.46Å; K93-R96 PolarHBondContact O-N 2.86Å; A94-R96 PolarHBondContact O-N 3.3Å; R96-L98 VanDerWaalsContact C-N 3.3Å; R96-L98 PolarHBondContact O-N 2.71Å; R96-F99 PolarHBondContact O-N 3.27Å; R96-M100 WeakPolarHBondContact O-CG 3.4Å; R96-M100 PolarHBondContact O-N 2.89Å
97	S	77.7	Confident	73.9	Confident	74 Å²	74	78.5 Å²	78.5	52%	0.517	41%	0.405	S	S	.	.	H	α-helix	trans	-57.6	-46.2	171.7	-168.4	0	0	0	0	110.8	K93 A94 M100 T101	K93-S97 WeakPolarHBondContact O-CB 3.24Å; K93-S97 PolarHBondContact O-N 3.48Å; A94-S97 PolarHBondContact O-N 3.49Å; S97-M100 PolarHBondContact O-N 2.88Å; S97-T101 PolarHBondContact O-N 3.02Å; S97-T101 PolarHBondContact O-OG1 3.35Å; S97-T101 VanDerWaalsContact O-OG1 3.07Å
98	L	77.7	Confident	74.7	Confident	45 Å²	45	77.9 Å²	77.9	24%	0.236	41%	0.405	C	S	.	.	H	α-helix	trans	-62.4	-44.4	178.2	-177.7	64	0	0	0	111.9	L27 I52 A94 K95 R96 M100 T101 V102	L27-L98 HydrophobicContact CD1-CD1 4.07Å; L27-L98 HydrophobicContact CD2-CD1 3.76Å; L27-L98 HydrophobicContact CG-CD1 4.47Å; I52-L98 HydrophobicContact CD1-CD2 3.72Å; I52-L98 HydrophobicContact CD1-CG 3.81Å; I52-L98 HydrophobicContact CG1-CD2 4.39Å; A94-L98 PolarHBondContact O-N 3.38Å; K95-L98 WeakPolarHBondContact O-CB 3.28Å; K95-L98 PolarHBondContact O-N 2.88Å; R96-L98 VanDerWaalsContact C-N 3.3Å; R96-L98 PolarHBondContact O-N 2.71Å; L98-M100 PolarHBondContact O-N 3.14Å; L98-T101 PolarHBondContact O-N 2.91Å; L98-V102 HydrophobicContact CD1-CG2 4.39Å; L98-V102 WeakPolarHBondContact O-CG2 3.49Å; L98-V102 PolarHBondContact O-N 3.03Å
99	F	78.9	Confident	75.3	Confident	57 Å²	57	75.5 Å²	75.5	25%	0.25	38%	0.384	C	S	.	.	H	α-helix	trans	-56.5	-49.7	175	178.7	-88.7	0	0	0	111.6	L49 I52 K95 R96 T101 V102 F103	L49-F99 HydrophobicContact CD2-CD2 3.58Å; L49-F99 HydrophobicContact CD2-CE2 3.81Å; L49-F99 HydrophobicContact CD2-CG 4.17Å; I52-F99 HydrophobicContact CG2-CB 4.01Å; I52-F99 HydrophobicContact CG2-CD2 4.15Å; K95-F99 PolarHBondContact O-N 3.1Å; R96-F99 PolarHBondContact O-N 3.27Å; F99-T101 VanDerWaalsContact C-N 3.34Å; F99-T101 PolarHBondContact O-N 3.49Å; F99-V102 PolarHBondContact O-N 3.37Å; F99-F103 HydrophobicContact CE1-CB 4.36Å; F99-F103 VanDerWaalsContact O-CB 3.23Å; F99-F103 WeakPolarHBondContact O-CB 3.45Å; F99-F103 PolarHBondContact O-N 2.95Å
100	M	79.2	Confident	75.8	Confident	81 Å²	81	77.3 Å²	77.3	40%	0.399	38%	0.383	S	S	.	.	H	α-helix	trans	-60.9	-42.8	-180	-68.4	-59.4	-57.9	0	0	111.5	R96 S97 L98 F103 D104	R96-M100 WeakPolarHBondContact O-CG 3.4Å; R96-M100 PolarHBondContact O-N 2.89Å; S97-M100 PolarHBondContact O-N 2.88Å; L98-M100 PolarHBondContact O-N 3.14Å; M100-F103 PolarHBondContact O-N 3.13Å; M100-D104 WeakPolarHBondContact O-CB 3.46Å; M100-D104 PolarHBondContact O-N 3.49Å
101	T	79.3	Confident	76.2	Confident	66 Å²	66	75 Å²	75	41%	0.405	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-49.3	177.7	-57.1	0	0	0	0	112.2	S97 L98 F99 F103 D104 D105	S97-T101 PolarHBondContact O-N 3.02Å; S97-T101 PolarHBondContact O-OG1 3.35Å; S97-T101 VanDerWaalsContact O-OG1 3.07Å; L98-T101 PolarHBondContact O-N 2.91Å; F99-T101 VanDerWaalsContact C-N 3.34Å; F99-T101 PolarHBondContact O-N 3.49Å; T101-F103 VanDerWaalsContact C-N 3.3Å; T101-F103 PolarHBondContact O-N 3.27Å; T101-D104 PolarHBondContact O-N 3.16Å; T101-D105 PolarHBondContact O-N 3.12Å
102	V	78.5	Confident	76.6	Confident	10 Å²	10	76.1 Å²	76.1	6%	0.061	38%	0.378	C	S	.	.	H	α-helix	trans	-67.2	-35	179.8	179.4	0	0	0	0	111.1	M45 I48 L49 L98 F99 D105 L106	M45-V102 HydrophobicContact CB-CG1 4.03Å; M45-V102 HydrophobicContact SD-CG1 3.99Å; I48-V102 HydrophobicContact CG2-CG2 4.45Å; L49-V102 HydrophobicContact CD1-CG1 4.17Å; L49-V102 HydrophobicContact CD2-CB 3.65Å; L49-V102 HydrophobicContact CD2-CG1 3.69Å; L49-V102 HydrophobicContact CG-CB 4.16Å; L49-V102 HydrophobicContact CG-CG1 3.59Å; L98-V102 HydrophobicContact CD1-CG2 4.39Å; L98-V102 WeakPolarHBondContact O-CG2 3.49Å; L98-V102 PolarHBondContact O-N 3.03Å; F99-V102 PolarHBondContact O-N 3.37Å; V102-D105 PolarHBondContact O-N 3.01Å; V102-L106 WeakPolarHBondContact O-CG 3.45Å; V102-L106 PolarHBondContact O-N 3.26Å
103	F	78.8	Confident	76.7	Confident	93 Å²	93	78.9 Å²	78.9	41%	0.408	38%	0.383	S	S	.	.	H	α-helix	trans	-64.8	-44.8	175.6	-178.2	-95.8	0	0	0	112.2	F99 M100 T101 D105 L106 R107	F99-F103 HydrophobicContact CE1-CB 4.36Å; F99-F103 VanDerWaalsContact O-CB 3.23Å; F99-F103 WeakPolarHBondContact O-CB 3.45Å; F99-F103 PolarHBondContact O-N 2.95Å; M100-F103 PolarHBondContact O-N 3.13Å; T101-F103 VanDerWaalsContact C-N 3.3Å; T101-F103 PolarHBondContact O-N 3.27Å; F103-D105 VanDerWaalsContact C-N 3.34Å; F103-L106 PolarHBondContact O-N 3.33Å; F103-R107 WeakPolarHBondContact O-CB 3.47Å; F103-R107 PolarHBondContact O-N 2.9Å
104	D	78.4	Confident	76.5	Confident	82 Å²	82	76.5 Å²	76.5	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-41.2	177.1	-69.8	-25.4	0	0	0	111.2	M100 T101 L106 R107 L108	M100-D104 WeakPolarHBondContact O-CB 3.46Å; M100-D104 PolarHBondContact O-N 3.49Å; T101-D104 PolarHBondContact O-N 3.16Å; D104-L106 PolarHBondContact O-N 3.46Å; D104-R107 PolarHBondContact O-N 3.36Å; D104-L108 PolarHBondContact O-N 2.92Å
105	D	77.7	Confident	76.2	Confident	51 Å²	51	79.8 Å²	79.8	27%	0.273	38%	0.382	S	S	.	.	H	α-helix	trans	-60.6	-45.4	174.6	-74.3	-17	0	0	0	111.4	T101 V102 F103 R107 L108 V109	T101-D105 PolarHBondContact O-N 3.12Å; V102-D105 PolarHBondContact O-N 3.01Å; F103-D105 VanDerWaalsContact C-N 3.34Å; D105-R107 VanDerWaalsContact C-N 3.35Å; D105-R107 PolarHBondContact O-N 3.35Å; D105-L108 PolarHBondContact O-N 3.08Å; D105-V109 WeakPolarHBondContact O-CG2 3.39Å; D105-V109 PolarHBondContact O-N 3.39Å; D105-V109 VanDerWaalsContact O-N 3.1Å
106	L	75.9	Confident	75.7	Confident	20 Å²	20	83.7 Å²	83.7	11%	0.105	40%	0.399	C	S	.	.	H	α-helix	trans	-63.6	-39.8	177	-76	-173.6	0	0	0	112.6	F42 M45 L49 V102 F103 D104 L108 V109 E110	F42-L106 HydrophobicContact CD2-CD2 3.57Å; F42-L106 HydrophobicContact CE2-CD2 3.69Å; F42-L106 HydrophobicContact CG-CD2 4.32Å; M45-L106 HydrophobicContact CB-CD1 4.46Å; M45-L106 HydrophobicContact CB-CD2 3.63Å; M45-L106 HydrophobicContact CB-CG 4.12Å; L49-L106 HydrophobicContact CD1-CD1 3.3Å; L49-L106 HydrophobicContact CD1-CG 4.38Å; L49-L106 HydrophobicContact CG-CD1 4.33Å; V102-L106 WeakPolarHBondContact O-CG 3.45Å; V102-L106 PolarHBondContact O-N 3.26Å; F103-L106 PolarHBondContact O-N 3.33Å; D104-L106 PolarHBondContact O-N 3.46Å; L106-L108 VanDerWaalsContact C-N 3.35Å; L106-V109 WeakPolarHBondContact O-CB 3.47Å; L106-V109 PolarHBondContact O-N 2.93Å; L106-E110 PolarHBondContact O-N 2.88Å
107	R	78.6	Confident	74.9	Confident	140 Å²	140	80.6 Å²	80.6	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-62.8	-43.3	176.8	-175.7	-179.6	175.2	161.6	4.6	111.2	F103 D104 D105 V109 E110 E111	F103-R107 WeakPolarHBondContact O-CB 3.47Å; F103-R107 PolarHBondContact O-N 2.9Å; D104-R107 PolarHBondContact O-N 3.36Å; D105-R107 VanDerWaalsContact C-N 3.35Å; D105-R107 PolarHBondContact O-N 3.35Å; R107-V109 VanDerWaalsContact C-N 3.28Å; R107-V109 PolarHBondContact O-N 3.46Å; R107-E110 WeakPolarHBondContact O-CB 3.02Å; R107-E110 PolarHBondContact O-N 3.35Å; R107-E110 VanDerWaalsContact O-N 3.16Å; R107-E111 IonicContact NE-OE1 2.75Å; R107-E111 PolarHBondContact NE-OE1 2.93Å; R107-E111 IonicContact NH2-OE1 3.55Å; R107-E111 WeakPolarHBondContact O-CG 3.22Å; R107-E111 PolarHBondContact O-N 3.26Å
108	L	79.3	Confident	73.6	Confident	98 Å²	98	81.9 Å²	81.9	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-59.6	-41.1	175.8	-173.4	72.9	0	0	0	111.3	D104 D105 L106 E110 E111 L112	D104-L108 PolarHBondContact O-N 2.92Å; D105-L108 PolarHBondContact O-N 3.08Å; L106-L108 VanDerWaalsContact C-N 3.35Å; L108-E110 VanDerWaalsContact C-N 3.34Å; L108-E110 PolarHBondContact O-N 3Å; L108-E111 PolarHBondContact O-N 2.91Å; L108-L112 HydrophobicContact CG-CD1 4.31Å; L108-L112 WeakPolarHBondContact O-CB 3.28Å; L108-L112 VanDerWaalsContact O-CG 3.28Å; L108-L112 WeakPolarHBondContact O-CG 3.48Å; L108-L112 PolarHBondContact O-N 2.75Å
109	V	74.8	Confident	72.3	Confident	8 Å²	8	85.3 Å²	85.3	5%	0.048	43%	0.43	C	S	.	.	H	α-helix	trans	-63.5	-40.8	176.6	178	0	0	0	0	111.4	M36 F42 D105 L106 R107 L112 K113	M36-V109 HydrophobicContact CB-CG1 4.45Å; M36-V109 HydrophobicContact CB-CG2 3.92Å; M36-V109 HydrophobicContact CE-CG2 3.23Å; M36-V109 HydrophobicContact CG-CG2 4.05Å; M36-V109 HydrophobicContact SD-CG2 4.41Å; F42-V109 HydrophobicContact CD2-CG1 4.13Å; D105-V109 WeakPolarHBondContact O-CG2 3.39Å; D105-V109 PolarHBondContact O-N 3.39Å; D105-V109 VanDerWaalsContact O-N 3.1Å; L106-V109 WeakPolarHBondContact O-CB 3.47Å; L106-V109 PolarHBondContact O-N 2.93Å; R107-V109 VanDerWaalsContact C-N 3.28Å; R107-V109 PolarHBondContact O-N 3.46Å; V109-L112 PolarHBondContact O-N 2.99Å; V109-K113 WeakPolarHBondContact O-CG 3.13Å; V109-K113 PolarHBondContact O-N 3.23Å
110	E	75	Confident	70.9	Confident	98 Å²	98	87.6 Å²	87.6	46%	0.458	45%	0.453	S	S	.	.	H	α-helix	trans	-65.7	-42.1	177.2	-159.9	-165.3	146.4	0	0	111.8	L106 R107 L108 K113 K114	L106-E110 PolarHBondContact O-N 2.88Å; R107-E110 WeakPolarHBondContact O-CB 3.02Å; R107-E110 PolarHBondContact O-N 3.35Å; R107-E110 VanDerWaalsContact O-N 3.16Å; L108-E110 VanDerWaalsContact C-N 3.34Å; L108-E110 PolarHBondContact O-N 3Å; E110-K113 WeakPolarHBondContact O-CB 3.21Å; E110-K113 PolarHBondContact O-N 3.45Å; E110-K114 WeakPolarHBondContact O-CG 3.35Å; E110-K114 PolarHBondContact O-N 2.96Å; E110-K114 VanDerWaalsContact O-N 3.13Å; E110-K114 VanDerWaalsContact OE1-CE 3.28Å; E110-K114 WeakPolarHBondContact OE1-CE 3.23Å; E110-K114 IonicContact OE1-NZ 3.24Å; E110-K114 PolarHBondContact OE1-NZ 3.32Å
111	E	77.6	Confident	69.7	Low	88 Å²	88	92.8 Å²	92.8	41%	0.411	49%	0.492	S	S	.	.	H	α-helix	trans	-64.5	-42.6	175.5	-71.7	178.2	-171.5	0	0	111.8	R107 L108 K113 K114 L115	R107-E111 IonicContact NE-OE1 2.75Å; R107-E111 PolarHBondContact NE-OE1 2.93Å; R107-E111 IonicContact NH2-OE1 3.55Å; R107-E111 WeakPolarHBondContact O-CG 3.22Å; R107-E111 PolarHBondContact O-N 3.26Å; L108-E111 PolarHBondContact O-N 2.91Å; E111-K113 VanDerWaalsContact C-N 3.27Å; E111-K113 PolarHBondContact O-N 3.19Å; E111-K114 PolarHBondContact O-N 3.37Å; E111-K114 VanDerWaalsContact O-N 3.12Å; E111-L115 PolarHBondContact O-N 2.72Å
112	L	74.5	Confident	69.3	Low	89 Å²	89	94.1 Å²	94.1	47%	0.466	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-32.1	174.4	-74.1	173.1	0	0	0	112.9	L108 V109	L108-L112 HydrophobicContact CG-CD1 4.31Å; L108-L112 WeakPolarHBondContact O-CB 3.28Å; L108-L112 VanDerWaalsContact O-CG 3.28Å; L108-L112 WeakPolarHBondContact O-CG 3.48Å; L108-L112 PolarHBondContact O-N 2.75Å; V109-L112 PolarHBondContact O-N 2.99Å
113	K	72.8	Confident	68.8	Low	108 Å²	108	98.5 Å²	98.5	47%	0.47	52%	0.52	S	S	.	.	H	α-helix	trans	-66.5	-43.2	172.3	-77.5	176.6	178.5	178	0	111.2	V109 E110 E111 K116	V109-K113 WeakPolarHBondContact O-CG 3.13Å; V109-K113 PolarHBondContact O-N 3.23Å; E110-K113 WeakPolarHBondContact O-CB 3.21Å; E110-K113 PolarHBondContact O-N 3.45Å; E111-K113 VanDerWaalsContact C-N 3.27Å; E111-K113 PolarHBondContact O-N 3.19Å; K113-K116 PolarHBondContact O-N 2.83Å
114	K	72.6	Confident	68.2	Low	119 Å²	119	98.8 Å²	98.8	52%	0.517	53%	0.526	S	S	.	.	H	α-helix	trans	-64.6	-39.2	179.2	-69.2	171.8	-174.7	167.1	0	112.7	E110 E111 K116 T117	E110-K114 WeakPolarHBondContact O-CG 3.35Å; E110-K114 PolarHBondContact O-N 2.96Å; E110-K114 VanDerWaalsContact O-N 3.13Å; E110-K114 VanDerWaalsContact OE1-CE 3.28Å; E110-K114 WeakPolarHBondContact OE1-CE 3.23Å; E110-K114 IonicContact OE1-NZ 3.24Å; E110-K114 PolarHBondContact OE1-NZ 3.32Å; E111-K114 PolarHBondContact O-N 3.37Å; E111-K114 VanDerWaalsContact O-N 3.12Å; K114-K116 VanDerWaalsContact C-N 3.27Å; K114-K116 PolarHBondContact O-N 3.04Å; K114-T117 PolarHBondContact O-N 2.86Å; K114-T117 PolarHBondContact O-OG1 3.35Å
115	L	66.8	Low	67.6	Low	122 Å²	122	99.8 Å²	99.8	64%	0.639	53%	0.531	S	S	*	.	H	α-helix	trans	-66.2	-24.8	177.9	-75.5	166.5	0	0	0	113.8	E111 T118	E111-L115 PolarHBondContact O-N 2.72Å; L115-T118 PolarHBondContact O-OG1 3.02Å
116	K	61.5	Low	67	Low	133 Å²	133	102.9 Å²	102.9	58%	0.578	55%	0.547	S	S	*	.	H	α-helix	trans	-82.8	-19.4	176.2	-74.6	-177	178	-178.4	0	113.5	K113 K114	K113-K116 PolarHBondContact O-N 2.83Å; K114-K116 VanDerWaalsContact C-N 3.27Å; K114-K116 PolarHBondContact O-N 3.04Å
117	T	57.2	Low	66.4	Low	111 Å²	111	108.4 Å²	108.4	68%	0.681	58%	0.577	S	S	*	*	S	Bend	trans	-88.8	-3.6	-179.6	48.4	0	0	0	0	113.8	K114 P119	K114-T117 PolarHBondContact O-N 2.86Å; K114-T117 PolarHBondContact O-OG1 3.35Å; T117-P119 WeakPolarHBondContact O-CD 3.08Å
118	T	50.7	Low	65.5	Low	101 Å²	101	106.1 Å²	106.1	62%	0.62	58%	0.58	S	S	*	*	S	Bend	trans	-74.4	107.8	164.5	39.7	0	0	0	0	108.2	L115 S120	L115-T118 PolarHBondContact O-OG1 3.02Å; T118-S120 PolarHBondContact O-N 3.35Å
119	P	49.4	Very low	64.5	Low	117 Å²	117	106.8 Å²	106.8	76%	0.76	59%	0.585	S	S	*	*			trans	-59.6	134.1	171.9	27	-32.9	0	0	0	107.9	T117	T117-P119 WeakPolarHBondContact O-CD 3.08Å
120	S	50.7	Low	63.6	Low	104 Å²	104	115 Å²	115	73%	0.727	63%	0.63	S	S	*	*			trans	-50	138.5	158.1	169.9	0	0	0	0	107.9	T118	T118-S120 PolarHBondContact O-N 3.35Å
121	P	54.4	Low	62.6	Low	190 Å²	190	116.5 Å²	116.5	100%	1.234	65%	0.646	S	S	*	*			trans	-54.6	0	171.2	26.6	-34.6	0	0	0	111.6

Retrieved 121 of 121 residues in 65.3 ms (Link to these results)

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